[2-({[5-(2-chlorophenyl)-4-(3-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
Chemical Structure Depiction of
[2-({[5-(2-chlorophenyl)-4-(3-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
[2-({[5-(2-chlorophenyl)-4-(3-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V014-0147 |
| Compound Name: | [2-({[5-(2-chlorophenyl)-4-(3-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone |
| Molecular Weight: | 538.5 |
| Molecular Formula: | C27 H25 Cl2 N5 O S |
| Salt: | not_available |
| Smiles: | CN1CCN(CC1)C(c1ccccc1CSc1nnc(c2ccccc2[Cl])n1c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3179 |
| logD: | 5.1872 |
| logSw: | -5.7182 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.837 |
| InChI Key: | NLQHHQOZBMNAMZ-UHFFFAOYSA-N |